Grigor'ev Fedor Vsil'evich

Publications in Math-Net.Ru

1. Effect of nanoparticles on the structure of thin films: atomistic simulation results
   
   Num. Meth. Prog., 19:2 (2018),  173–177
2. Ring statistics in disordered solids: a parallel algorithm for clusters with hundred thousands of atoms
   
   Num. Meth. Prog., 18:4 (2017),  447–454
3. Mechanical losses in glassy silicon dioxide: results of atomistic simulation
   
   Num. Meth. Prog., 18:4 (2017),  381–386
4. Surface roughness of thin film atomistic nanometer-size clusters
   
   Num. Meth. Prog., 17:4 (2016),  455–459
5. An algorithm of high performance modeling of optical nanocoating deposition processes
   
   Num. Meth. Prog., 14:3 (2013),  323–327
6. High performance modeling of modern deposition processes for optical coating nanotechnology
   
   Num. Meth. Prog., 13:4 (2012),  491–496
7. The MEL program for the atomistic modeling of functional layers in solar cells
   
   Num. Meth. Prog., 13:3 (2012),  413–423
8. Calculation of molecular complexation free energy by thermodynamic integration with harmonic restrictions on atomic coordinates
   
   Num. Meth. Prog., 13:3 (2012),  391–397
9. The SOL docking package for computer-aided drug design
   
   Num. Meth. Prog., 9:3 (2008),  213–233
10. Computation of contribution from the cavity effect to protein-ligand binding free energy
    
    Num. Meth. Prog., 9:1 (2008),  101–107
11. A two-step method for the evaluation of free energy of formation for subnanometer cavities.
    
    Num. Meth. Prog., 8:4 (2007),  326–333
12. An algorithm of assigning the force parameters to atoms of organic molecules and proteins in the framework of the MMFF94 force field
    
    Num. Meth. Prog., 7:4 (2006),  128–136